(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(hydroxymethyl)-2-phenyl-butanoate hydrobromide

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(hydroxymethyl)-2-phenyl-butanoate hydrobromide Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(hydroxymethyl)-2-phenyl-butanoate hydrobromide CAS Name: 2-(hydroxymethyl)-2-phenylbutanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrobromide IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(hydroxymethyl)-2-phenylbutanoate hydrobromide Traditional Name: 2-methylol-2-phenyl-butyric acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrobromide Formula: C19H28BrNO3 MolecularWeight: 398.33452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C.Br

Isomeric SMILES

CCC(CO)(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C.Br

InChI

InChI=1S/C19H27NO3.BrH/c1-3-19(13-21,14-7-5-4-6-8-14)18(22)23-17-11-15-9-10-16(12-17)20(15)2;/h4-8,15-17,21H,3,9-13H2,1-2H3;1H